COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL477097
Chemical Name: ethyl6-(5-methyl-2-oxo-2,3-dihydro-1H-imidazol-4-yl)-6-oxo-5-thiocyanatohexanoate
Smiles: Cc1c(C(=O)C(SC#N)CCCC(=O)OCC)[nH]c(=O)[nH]1

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Molecular Weight: 311.36
Empirical Formula: C13H17N3O4S

Physical State: Dry powder
Available Amount: 58 mg

Lipinsky:
logP: 3.297
Rotatable bonds: 9
H-donors: 2
H-acceptors: 4
PSA: 133
Number of rings: 1

     

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